Vitas-M small molecule compound
8-chloro-N-(2,4-dimethylphenyl)-3-(4-ethylphenyl)-2-methyl-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxamide
Catalog ID
STL192534
SMILES CCc1ccc(cc1)N1C(=S)NC2C(C1(C)Oc1c2cc(cc1)Cl)C(=O)Nc1ccc(cc1C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H28ClN3O2S MW 506.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28ClN3O2S/c1-5-18-7-10-20(11-8-18)32-27(35)31-25-21-15-19(29)9-13-23(21)34-28(32,4)24(25)26(33)30-22-12-6-16(2)14-17(22)3/h6-15,24-25H,5H2,1-4H3,(H,30,33)(H,31,35)InChIKey
PZDZWKNQSFYZCT-UHFFFAOYSA-NSynonyms
1023549-20-31023549203
8chloroN(24dimethylphenyl)3(4ethylphenyl)2methyl4thioxo3456tetrahydro2H26methano135benzoxadiazocine11carboxamide
CCC1=CC=C(C=C1)N2C(=S)NC3C(C2(OC4=C3C=C(C=C4)Cl)C)C(=O)NC5=C(C=C(C=C5)C)C
InChI=1SC28H28ClN3O2Sc151871020(11818)3227(35)3125211519(29)91323(21)3428(324)24(25)26(33)302212616(2)1417(22)3h6152425H5H214H3(H3033)(H3135)
MFCD15086215
ZINC000100031854
ZINC000242620223
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